[5-methyl-2-phenyl-1-(phenylmethyl)indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone

Systemtic Name: [5-methyl-2-phenyl-1-(phenylmethyl)indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Openeye Name: (1-benzyl-5-methyl-2-phenyl-indol-3-yl)-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: [5-methyl-2-phenyl-1-(phenylmethyl)-3-indolyl]-[4-(2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (1-benzyl-5-methyl-2-phenylindol-3-yl)-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Traditional Name: (1-benzyl-5-methyl-2-phenyl-indol-3-yl)-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C33H32N4O MolecularWeight: 500.63338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C33H32N4O/c1-25-16-17-29-28(23-25)31(33(38)36-20-10-19-35(21-22-36)30-15-8-9-18-34-30)32(27-13-6-3-7-14-27)37(29)24-26-11-4-2-5-12-26/h2-9,11-18,23H,10,19-22,24H2,1H3